NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 682 Y 4.7878 8.2445 118.3225 57.8965 39.3131 174.5140 683 K 4.6895 8.7998 128.5907 50.6095 35.3266 169.6399 684 P 4.9864 0.0000 0.0000 62.6451 33.0920 175.3480 685 V 5.0152 9.2725 116.2443 59.6108 36.7566 173.9660 686 F 5.1755 9.1432 125.6336 56.5182 41.5586 174.5667 687 V 4.3876 8.0887 127.7094 62.7808 31.7817 176.1837 688 T 4.7020 8.5591 117.9337 62.3357 71.0825 174.5293 689 E 4.8839 8.0668 121.9945 55.2856 33.2436 173.5585 690 I 5.1068 8.8616 128.6675 60.0310 38.8344 176.0123 691 T 4.5254 9.0405 117.8581 60.4266 70.1610 175.6652 692 D 4.4517 8.6499 121.7167 57.2658 40.9167 177.2264 693 D 4.6756 8.1035 117.0854 53.4754 40.7592 175.7108 694 L 3.7443 7.8093 119.4016 56.5971 41.0008 174.0388 695 H 4.9751 7.9128 113.8869 54.4698 31.4710 173.9887 696 F 5.4527 8.0234 112.6956 56.2600 41.4183 172.8984 697 Y 5.1744 9.4956 118.5661 56.7618 40.5455 175.2498 698 V 5.1327 8.9283 114.6634 60.0379 36.8010 174.2332 699 Q 5.3327 9.0385 121.4956 53.4648 31.6239 174.8705 700 D 4.7268 8.6126 122.8140 53.7044 41.9845 177.2786 701 V 3.6912 8.4216 126.8339 65.7658 31.7531 177.5919 702 E 4.0609 8.5388 120.1083 58.3421 29.7837 177.2392 703 T 4.7546 7.8545 107.8111 61.2665 69.3439 176.3241 704 G 3.5901 8.2027 112.0869 48.6769 0.0000 176.4705 705 T 3.9077 7.8422 111.9966 64.4144 68.8021 176.5728 706 Q 3.9693 8.0114 120.4401 58.6316 28.8410 178.2662 707 L 3.9284 7.9462 121.2711 58.2094 42.1666 178.6196 708 E 3.9300 8.3602 119.3734 59.0921 29.5473 178.6678 709 K 3.9252 8.4492 120.1466 59.2466 32.2845 178.4848 710 L 3.9743 8.1269 120.6978 58.4623 42.0847 178.5407 711 M 3.8382 7.9980 118.5015 58.6083 31.9689 178.4471 712 E 3.8761 8.0284 118.2050 59.7872 29.7258 179.4698 713 N 4.3513 8.0962 116.2177 56.2614 38.5990 177.1829 714 M 2.5500 7.7889 119.8960 58.2809 32.1791 178.5975 715 R 3.8248 8.1965 118.4557 59.0473 30.2215 178.5186 716 N 4.2551 8.0888 116.9899 56.8192 39.0615 176.4828 717 D 4.5002 8.2077 119.3254 57.0357 41.0546 178.3294 718 I 3.4982 7.5760 119.7149 64.2561 37.1614 177.7438 719 A 4.1233 7.6682 120.2053 55.2816 18.1834 179.2973 720 S 4.3984 7.5075 110.7406 59.8600 64.5290 174.3685 721 H 4.8757 7.6908 116.9028 53.6309 28.8868 171.4448 722 P 4.4521 0.0000 0.0000 61.3171 32.6979 175.2802 723 P 4.1806 0.0000 0.0000 62.7531 31.8405 176.2156 724 V 3.7867 8.5205 121.8274 64.2683 31.6131 175.6499 725 E 3.8144 9.8404 127.0721 57.4236 27.3741 174.8419 726 G 4.0521 8.7184 103.4459 46.0743 0.0000 173.9368 727 S 5.2585 7.8009 112.0258 57.2914 66.3483 172.9421 728 Y 4.7543 8.9428 121.8397 56.5027 41.8493 174.5013 729 A 4.5515 7.8696 129.2200 49.3900 19.2544 174.2686 730 P 4.3859 0.0000 0.0000 62.8539 32.7623 177.1194 731 R 4.2561 8.7195 119.1066 54.7954 31.1160 176.2243 732 R 3.9807 8.2845 119.4592 58.3999 30.1425 176.6867 733 G 3.8987 8.9945 114.2634 45.1344 0.0000 173.2376 734 E 4.2366 7.9714 121.8275 56.0251 30.6264 176.3282 735 F 4.9749 8.9907 125.3796 58.1164 40.3760 174.1441 736 C 4.9455 9.3399 115.8390 57.9774 33.3506 172.2020 737 I 5.2618 8.7207 111.7676 59.4720 40.2563 174.6184 738 A 5.4493 9.3589 124.5623 50.3069 22.8658 175.1705 739 K 4.2890 8.7721 123.7321 55.2750 32.6599 176.7455 740 F 5.0680 9.0864 130.3326 56.5226 40.4099 176.3829 741 V 3.2959 6.0117 115.0561 63.5799 31.1167 177.0457 742 D 4.3907 7.5424 117.4222 53.0353 39.5615 177.0393 743 G 3.7590 8.1213 107.8784 46.0434 0.0000 173.2188 744 E 4.6366 8.2635 118.8648 54.0551 32.4828 175.1626 745 W 5.1568 8.4079 121.8608 56.6196 30.3016 175.3848 746 Y 4.9840 9.3345 120.4934 56.0396 42.1587 174.9282 747 R 4.7310 8.9081 119.8444 56.7638 31.7136 175.6344 748 A 4.7982 9.2950 123.7492 50.9334 23.8077 174.6859 749 R 4.8029 8.8248 118.3377 54.4837 33.8091 174.3703 750 V 4.1049 8.5735 126.7256 63.3059 31.9281 176.1234 751 E 4.3014 9.3831 127.8026 57.8835 31.0279 176.6066 752 K 4.4831 7.7318 118.5927 55.1163 35.9734 175.0667 753 V 4.5832 8.3107 126.3598 61.2740 32.6769 174.8912 754 E 4.1755 9.1155 128.6948 58.7680 29.9681 176.7843 755 S 4.5542 7.3136 110.4884 57.0031 65.3217 174.3851 756 P 4.2452 0.0000 0.0000 64.9342 31.0566 178.0824 757 A 4.4660 7.5103 118.6526 52.6918 19.3900 177.6889 758 K 4.6120 7.9353 115.3254 53.9921 33.5527 173.3354 759 I 4.7650 9.1900 123.4897 59.5632 40.1494 174.1853 760 H 5.0648 9.4765 125.7723 55.1442 29.8393 175.0476 761 V 4.8903 8.8755 117.1169 59.3554 35.5458 174.5187 762 F 5.1889 8.7117 124.3999 56.6527 41.8496 173.7883 763 Y 4.7075 8.5625 125.2230 57.1685 37.7140 176.3635 764 I 3.8110 8.4151 119.7132 63.2137 38.5221 177.4435 765 D 4.8910 8.3424 120.1767 54.5736 41.5032 176.2608 766 Y 4.2369 7.8890 114.7262 57.7558 40.5259 176.7145 767 G 2.5930 8.3242 107.0753 44.1144 0.0000 173.1216 768 N 4.8828 7.4080 117.0825 52.5554 39.2313 174.1252 769 R 5.3187 8.3867 117.3894 54.8263 33.9948 174.6468 770 E 4.7629 9.0019 120.9824 55.1259 33.8339 173.8789 771 V 4.6269 8.3811 125.7464 61.4803 32.7815 174.7258 772 L 5.0746 8.9560 128.1663 52.1001 45.8341 174.5990 773 P 4.9982 0.0000 0.0000 62.1401 32.7806 177.3658 774 S 4.3262 8.9899 115.9501 61.4847 62.8675 176.4352 775 T 4.7064 7.8794 108.8844 63.0343 68.8923 174.7743 776 R 4.7073 8.2511 121.4763 55.9223 31.4133 175.2732 777 L 5.7924 8.2834 117.7750 53.5305 45.9944 175.3158 778 G 4.0594 9.0780 106.7537 45.1392 0.0000 172.2374 779 T 3.7492 7.7169 116.4354 63.0814 69.2609 174.5897 780 L 4.4607 8.2029 127.4682 53.3236 42.8662 176.1717 781 S 4.2078 8.7235 121.5768 57.6902 63.0508 173.3807 782 P 4.1921 0.0000 0.0000 64.9986 31.2822 178.4485 783 A 3.7441 7.2385 120.0136 53.9636 18.1534 178.0079 784 F 4.9865 7.4521 113.4848 56.8294 40.0323 176.0081 785 S 4.3897 7.6512 118.1984 57.8682 64.9133 174.4554 786 T 4.8059 7.6183 112.6216 63.2605 68.6802 176.1666 787 R 4.0548 7.6007 120.7335 58.4639 30.1882 178.5909 788 V 3.8626 7.4021 117.2206 63.8390 32.2312 175.6204 789 L 4.6563 7.6880 120.2850 52.2265 44.5054 174.0610 790 P 4.6573 0.0000 0.0000 62.1785 31.9626 175.7614 791 A 4.2229 8.5563 121.5472 53.5760 18.1348 177.7791 792 Q 4.3199 9.7661 120.6871 56.7429 30.3267 175.3126 793 A 5.0125 7.7704 121.3157 50.9058 20.4194 176.7387 794 T 4.5796 8.8891 119.1889 61.5134 71.7601 173.0701 795 E 3.8991 8.2876 126.9786 55.6831 30.6532 174.9020 796 Y 4.5373 8.2912 122.8865 56.0071 42.8460 173.8755 797 A 4.6169 8.0076 121.5855 49.6041 22.6764 175.7040 798 F 4.8232 8.6023 118.4155 57.3467 39.4362 175.5601 799 A 3.7218 9.0062 126.1778 52.5049 19.4082 178.0744 800 F 4.2118 8.7039 117.8500 57.6915 36.4452 174.3697 801 I 5.2301 7.2976 112.9090 59.2920 40.4400 174.6278 802 Q 4.6836 8.9855 123.1360 54.3901 30.3587 175.6095 803 V 3.9244 8.3868 124.0448 61.6053 32.3918 174.0172 804 P 4.2064 0.0000 0.0000 63.9930 31.6411 177.1440 805 Q 4.1703 8.6079 121.1871 57.2642 28.7716 173.9461 806 D 4.5628 7.8658 116.3552 54.2438 43.0008 176.5315 807 D 4.3257 8.5894 126.6004 57.7990 41.0969 178.8301 808 D 4.3496 8.1511 118.6688 56.9735 40.8823 178.5527 809 A 3.9268 8.3510 121.4546 55.1886 18.3948 179.6108 810 R 3.8503 8.2112 117.4662 59.8619 30.1167 178.8107 811 T 3.8853 8.1176 115.5710 66.7301 68.4852 176.1420 812 D 4.3536 8.1796 120.5174 57.3934 40.9017 178.9571 813 A 3.9238 8.0064 121.0392 55.0693 18.3470 179.7032 814 V 3.5789 8.1528 117.1971 66.4623 31.6105 177.8378 815 D 4.3718 8.6746 118.7848 57.4468 40.6444 178.8405 816 S 4.0787 8.0361 113.4453 61.4880 62.3819 176.4771 817 V 3.6374 7.7771 120.8291 65.7623 31.3705 178.0595 818 V 3.5714 8.1443 118.3553 66.1897 31.2183 177.9910 819 R 3.9514 7.8304 116.2841 59.6590 30.0360 178.4286 820 D 4.6738 8.0708 117.3224 56.1854 41.2496 177.3665 821 I 4.7287 8.2350 109.8141 58.8969 39.2269 175.1219 822 Q 3.8685 7.7921 122.8251 57.3148 29.1440 175.4053 823 N 3.9518 8.9282 123.8582 54.4142 36.2702 173.9434 824 T 4.8763 6.8289 106.1096 59.8831 73.0273 173.0048 825 Q 4.7184 8.8401 123.9638 56.4757 30.2326 174.4411 826 C 4.9908 9.4936 122.3838 58.3980 33.6614 172.3715 827 L 5.2389 8.7275 119.6131 53.2342 43.8070 175.7987 828 L 5.1824 9.1377 124.6829 53.2230 45.7407 174.5128 829 N 4.7580 8.6495 123.7232 51.3407 41.7683 173.2711 830 V 3.8802 8.2714 126.8126 63.3568 31.7075 175.0755 831 E 4.6062 9.0967 128.8235 58.6493 30.0987 176.3174 832 H 5.0692 7.5439 112.9726 54.1638 31.9582 172.8600 833 L 4.4971 8.5997 120.0266 54.6970 42.5142 176.8630 834 S 4.8936 7.9871 114.7444 56.8686 65.4261 173.3524 835 A 4.2681 8.7155 121.3388 54.2273 19.4820 178.7035 836 G 4.1383 7.2421 103.6757 45.6327 0.0000 175.4084 837 C 4.2036 8.5119 122.2561 58.4046 28.8147 171.4232 838 P 4.4333 0.0000 0.0000 63.3047 32.4849 174.7791 839 H 5.1813 9.0021 120.3014 54.6582 30.6470 174.8016 840 V 4.8892 8.6417 115.7253 59.7495 36.4305 174.3561 841 T 5.0135 8.4632 112.0850 60.2370 71.3759 173.4020 842 L 5.3643 8.6231 122.7137 53.2086 45.2616 175.1705 843 Q 5.0008 8.7988 120.7825 53.6525 32.2341 175.2211 844 F 4.4617 8.3703 121.7937 57.8374 39.6348 176.6071 845 A 3.9309 9.0708 128.0005 55.9440 17.8950 178.7356 846 D 4.5691 7.4375 114.5080 55.3687 40.2876 179.2710 847 S 4.2209 7.9199 114.3633 59.0295 63.8004 176.3087 848 K 4.0472 8.0172 119.1439 56.6311 30.6506 176.1917 849 G 3.8061 7.7388 108.9693 45.0761 0.0000 172.8705 850 D 4.7388 8.6002 122.1396 53.8523 42.2754 177.3813 851 V 3.3786 8.6414 127.7657 65.9585 31.6294 178.3125 852 G 3.1649 7.9614 105.0223 47.4543 0.0000 175.1144 853 L 3.2297 8.1988 122.9319 57.5787 41.9859 179.1481 854 G 3.6933 7.8857 105.5397 48.0029 0.0000 175.5948 855 L 3.9456 7.5017 120.7503 57.3259 41.4962 179.7865 856 V 3.7341 7.5226 118.2415 65.9433 31.2751 177.9701 857 K 4.0371 8.0051 118.4619 59.4186 32.1410 177.6611 858 E 4.2267 8.1223 116.9187 56.1776 29.8563 176.8585 859 G 4.1062 8.2202 106.5765 47.3077 0.0000 175.6928 860 L 4.1087 8.0164 121.4665 56.1958 42.0705 177.4024 861 V 4.5721 7.2556 109.3122 59.8907 35.9501 174.9358 862 M 4.9048 8.4820 121.8266 54.4070 34.3397 175.4186 863 V 4.4557 8.9659 121.4604 62.7379 32.6394 175.1218 864 E 4.3206 8.9271 129.7619 55.1894 30.0398 176.7796 865 V 3.9621 8.4350 128.4045 61.4808 30.1404 175.5586 866 R 4.2068 8.0525 123.1552 55.9292 30.8220 176.8993 867 K 4.3281 7.8766 119.5437 57.6712 33.2642 177.8418 868 E 3.9461 8.2615 118.7030 56.4322 30.1436 177.7067 869 K 3.8177 8.8119 124.3123 59.6615 31.9557 178.6527 870 Q 4.0089 7.7745 116.0414 58.0598 28.7099 177.1894 871 F 4.9662 7.8588 121.3797 57.9488 39.3830 177.9157 872 Q 4.0108 7.8561 122.3425 60.2827 27.9061 183.8584 873 K 4.1873 7.9525 120.4796 59.2038 32.1259 179.7792 874 V 3.5958 7.6019 118.9420 64.7373 31.3084 178.2062 875 I 3.4110 7.7141 120.8276 64.2683 36.8608 178.3445 876 T 3.8503 7.8696 116.4207 66.7103 68.3413 176.0738 877 E 3.9708 8.2036 120.9846 59.7168 29.6038 178.5493 878 Y 4.0971 8.5324 116.9381 61.1093 37.8735 178.4898 879 L 4.0614 8.5674 120.4244 57.6762 41.6567 179.2909 880 N 4.3108 8.6096 116.8177 56.3118 38.4531 177.3172 881 A 4.0031 8.1229 122.1490 54.9907 18.3041 179.5420 882 Q 3.9123 8.2778 118.4625 59.1389 29.1685 177.6950 883 E 3.6841 8.4147 120.8712 59.3948 29.5815 178.5784 884 S 3.9790 7.9794 112.5805 61.5655 62.5589 175.8807 885 A 4.0376 8.1441 123.2753 55.0516 18.2340 179.5097 886 K 3.3310 7.9680 118.3802 59.5718 32.0184 179.3192 887 S 4.1143 7.7522 112.7827 61.0040 63.0000 175.2934 888 A 4.2507 7.7917 121.5071 51.2144 18.9180 177.0050 889 R 4.0772 7.7882 115.7043 57.0719 28.5762 175.8583 890 L 4.6304 7.9566 117.0007 54.8980 44.7096 177.5074 891 N 4.0253 9.3566 120.4932 54.1375 37.7139 176.5818 892 L 3.6578 5.6200 126.7366 57.6834 42.4019 178.0087 893 W 5.2365 7.7354 116.2306 55.6957 29.3109 177.9578 894 R 4.1814 7.6518 120.0149 58.4371 29.3543 177.2681 895 Y 4.7211 7.4222 111.6807 57.5010 39.0031 174.4403 896 G 3.9308 7.6646 106.0346 44.1411 0.0000 174.0845 897 D 4.7683 8.7496 118.8364 54.7048 41.2830 177.0319 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 682 Y 8.24 4.79 0.00 2.90 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 683 K 8.80 4.69 0.00 1.42 1.64 0.00 1.81 0.00 0.00 1.67 0.00 0.00 2.86 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.27 1.32 7.81 684 P 0.00 4.99 0.00 2.16 2.26 0.00 3.65 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.04 0.00 685 V 9.27 5.02 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 1.00 0.00 0.00 686 F 9.14 5.18 0.00 3.14 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 687 V 8.09 4.39 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.76 0.00 0.00 688 T 8.56 4.70 4.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 689 E 8.07 4.88 0.00 2.11 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.64 0.00 690 I 8.86 5.11 1.96 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.05 1.05 0.00 0.00 691 T 9.04 4.53 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 692 D 8.65 4.45 0.00 2.73 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 693 D 8.10 4.68 0.00 2.53 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 694 L 7.81 3.74 0.00 1.87 1.87 1.08 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 695 H 7.91 4.98 0.00 3.06 3.01 0.00 5.70 0.00 0.00 0.00 0.00 6.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 696 F 8.02 5.45 0.00 3.19 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 697 Y 9.50 5.17 0.00 2.99 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 698 V 8.93 5.13 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 1.18 0.00 0.00 699 Q 9.04 5.33 0.00 2.09 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 7.01 0.00 0.00 0.00 0.00 0.00 2.22 2.09 0.00 700 D 8.61 4.73 0.00 2.74 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 701 V 8.42 3.69 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 1.02 0.00 0.00 702 E 8.54 4.06 0.00 1.99 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.27 0.00 703 T 7.85 4.75 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 704 G 8.20 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 705 T 7.84 3.91 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 706 Q 8.01 3.97 0.00 2.35 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.94 0.00 0.00 0.00 0.00 0.00 2.46 2.49 0.00 707 L 7.95 3.93 0.00 1.76 1.79 0.95 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 708 E 8.36 3.93 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0.00 0.00 0.00 799 A 9.01 3.72 0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 800 F 8.70 4.21 0.00 2.78 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 801 I 7.30 5.23 1.96 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.77 1.15 0.00 0.00 802 Q 8.99 4.68 0.00 1.97 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.62 6.88 0.00 0.00 0.00 0.00 0.00 2.38 2.37 0.00 803 V 8.39 3.92 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 1.08 0.00 0.00 804 P 0.00 4.21 0.00 2.13 1.94 0.00 3.74 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.11 0.00 805 Q 8.61 4.17 0.00 2.07 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.94 0.00 0.00 0.00 0.00 0.00 2.28 1.91 0.00 806 D 7.87 4.56 0.00 2.76 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 807 D 8.59 4.33 0.00 2.73 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 808 D 8.15 4.35 0.00 2.82 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 809 A 8.35 3.93 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 810 R 8.21 3.85 0.00 2.16 2.08 0.00 3.13 0.00 0.00 3.40 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.70 0.00 811 T 8.12 3.89 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 812 D 8.18 4.35 0.00 2.86 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 813 A 8.01 3.92 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 814 V 8.15 3.58 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 1.12 0.00 0.00 815 D 8.67 4.37 0.00 2.84 2.72 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 824 T 6.83 4.88 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 825 Q 8.84 4.72 0.00 2.34 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.65 6.84 0.00 0.00 0.00 0.00 0.00 2.43 2.73 0.00 826 C 9.49 4.99 0.00 2.74 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 827 L 8.73 5.24 0.00 1.64 1.78 0.88 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 828 L 9.14 5.18 0.00 1.57 1.36 0.26 -0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 829 N 8.65 4.76 0.00 1.44 1.87 0.00 0.00 6.65 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 830 V 8.27 3.88 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.87 0.00 0.00 831 E 9.10 4.61 0.00 1.70 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.36 0.00 0.00 0.91 0.00 0.00 841 T 8.46 5.01 4.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 842 L 8.62 5.36 0.00 1.54 1.43 0.09 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 843 Q 8.80 5.00 0.00 1.80 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.95 0.00 0.00 0.00 0.00 0.00 2.13 2.17 0.00 844 F 8.37 4.46 0.00 3.02 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 845 A 9.07 3.93 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 846 D 7.44 4.57 0.00 2.71 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 847 S 7.92 4.22 0.00 3.96 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 848 K 8.02 4.05 0.00 1.91 1.96 0.00 1.63 0.00 0.00 1.76 0.00 0.00 2.93 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.34 1.49 7.81 849 G 7.74 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 850 D 8.60 4.74 0.00 2.81 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 851 V 8.64 3.38 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 -0.07 0.00 0.00 852 G 7.96 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 853 L 8.20 3.23 0.00 1.46 1.68 0.41 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 854 G 7.89 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 855 L 7.50 3.95 0.00 1.72 1.60 0.45 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 856 V 7.52 3.73 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.92 0.00 0.00 857 K 8.01 4.04 0.00 1.74 1.95 0.00 1.71 0.00 0.00 1.59 0.00 0.00 3.04 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.43 1.48 7.81 858 E 8.12 4.23 0.00 2.10 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.35 0.00 859 G 8.22 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 860 L 8.02 4.11 0.00 1.73 1.68 0.89 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 861 V 7.26 4.57 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.00 0.92 0.00 0.00 862 M 8.48 4.90 0.00 2.16 2.06 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.73 0.00 863 V 8.97 4.46 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 1.12 0.00 0.00 864 E 8.93 4.32 0.00 2.10 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.31 0.00 865 V 8.43 3.96 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.98 0.00 0.00 866 R 8.05 4.21 0.00 1.93 2.26 0.00 3.48 0.00 0.00 3.39 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.65 0.00 867 K 7.88 4.33 0.00 1.85 1.88 0.00 1.64 0.00 0.00 1.73 0.00 0.00 3.08 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.43 1.45 7.81 868 E 8.26 3.95 0.00 2.03 1.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.37 0.00 869 K 8.81 3.82 0.00 1.77 1.74 0.00 1.69 0.00 0.00 1.83 0.00 0.00 2.99 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.47 1.48 7.81 870 Q 7.77 4.01 0.00 1.92 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.71 0.00 0.00 0.00 0.00 0.00 1.91 1.43 0.00 871 F 7.86 4.97 0.00 3.12 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 872 Q 7.86 4.01 0.00 2.10 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.64 6.81 0.00 0.00 0.00 0.00 0.00 2.30 2.28 0.00 873 K 7.95 4.19 0.00 1.79 1.89 0.00 1.64 0.00 0.00 1.88 0.00 0.00 3.01 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.53 1.49 7.81 874 V 7.60 3.60 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.21 0.00 0.00 0.60 0.00 0.00 875 I 7.71 3.41 1.82 0.00 0.00 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.77 0.88 0.00 0.00 876 T 7.87 3.85 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 877 E 8.20 3.97 0.00 2.18 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.41 0.00 878 Y 8.53 4.10 0.00 3.10 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 879 L 8.57 4.06 0.00 1.83 1.72 0.93 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 880 N 8.61 4.31 0.00 2.91 2.86 0.00 0.00 6.83 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 881 A 8.12 4.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 882 Q 8.28 3.91 0.00 2.21 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.70 0.00 0.00 0.00 0.00 0.00 2.13 2.54 0.00 883 E 8.41 3.68 0.00 2.15 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.29 0.00 884 S 7.98 3.98 0.00 3.91 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 885 A 8.14 4.04 1.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 886 K 7.97 3.33 0.00 1.48 1.50 0.00 0.61 0.00 0.00 0.94 0.00 0.00 2.62 0.00 0.00 2.55 0.00 0.00 0.00 0.00 0.81 0.21 7.81 887 S 7.75 4.11 0.00 4.03 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 888 A 7.79 4.25 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 889 R 7.79 4.08 0.00 2.04 1.99 0.00 3.34 0.00 0.00 3.33 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.74 0.00 890 L 7.96 4.63 0.00 1.88 1.68 0.99 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 891 N 9.36 4.03 0.00 2.83 2.27 0.00 0.00 7.14 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 892 L 5.62 3.66 0.00 0.62 0.53 0.61 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 893 W 7.74 5.24 0.00 3.38 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 894 R 7.65 4.18 0.00 1.24 0.99 0.00 2.81 0.00 0.00 2.93 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.56 0.00 895 Y 7.42 4.72 0.00 3.04 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 896 G 7.66 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 897 D 8.75 4.77 0.00 2.70 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00